| SpectraBase Compound ID | K0gR5afKlaD |
|---|---|
| InChI | InChI=1S/C21H30O4/c1-14-7-10-21-16(13-25-19(21)23-3)5-4-6-17(21)20(14,2)9-8-15-11-18(22)24-12-15/h5,11,14,17,19H,4,6-10,12-13H2,1-3H3/t14-,17-,19?,20+,21+/m0/s1 |
| InChIKey | JHWHWTQRTHXYBD-IAJPGQIJSA-N |
| Mol Weight | 346.47 g/mol |
| Molecular Formula | C21H30O4 |
| Exact Mass | 346.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9xjcXJoHPf4 |
|---|---|
| Name | Methyl-amphiacrolide C |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O4 |
| InChI | InChI=1S/C21H30O4/c1-14-7-10-21-16(13-25-19(21)23-3)5-4-6-17(21)20(14,2)9-8-15-11-18(22)24-12-15/h5,11,14,17,19H,4,6-10,12-13H2,1-3H3/t14-,17-,19?,20+,21+/m0/s1 |
| InChIKey | JHWHWTQRTHXYBD-IAJPGQIJSA-N |
| Molecular Weight | 346.467 g/mol |
| SMILES | [C@]123[C@]([C@@](CCC4=CC(=O)OC4)(C)[C@](CC1)(C)[H])(CCC=C2COC3OC)[H] |
| SPLASH | splash10-00kr-0094000000-4019aef1963db6079e19 |
| Source of Spectrum | X2-53-1324-11 |
| Wiley ID | 1603748 |